Geometry & MOs

Info

ID:	129470
PubChem CID:	51072699
Reduced:	NOF4H7C9 (1)
Stoich.:	ABC4D7E9 (1)
Weight, g/mol:	259.082013
ΔH_f, kcal/mol:	-227.99
Dipole, Da:	4.07
IP(EA), eV:	-10.36(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-methoxyphenyl)-N-(2,2,2-trifluoroethyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCC(F)(F)F)F

DOS

IR

Vibrations